Aspisol

CAS Registry Number®

62952-06-1
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CAS Name

Aspisol

Molecular Formula

C9H8O4.C6H14N2O2

Cite this Page

Aspisol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?ref=62952-06-1 (retrieved 2022-12-05) (CAS RN: 62952-06-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    155 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C9H8O4.C6H14N2O2/c1-6(10)13-8-5-3-2-4-7(8)9(11)12;7-4-2-1-3-5(8)6(9)10/h2-5H,1H3,(H,11,12);5H,1-4,7-8H2,(H,9,10)

InChIKey

InChIKey=JJBCTCGUOQYZHK-UHFFFAOYSA-N

SMILES

C(O)(=O)C1=C(OC(C)=O)C=CC=C1.C(CCCCN)(C(O)=O)N

Canonical SMILES

O=C(O)C=1C=CC=CC1OC(=O)C.O=C(O)C(N)CCCCN

Other Names for this Substance

  • Lysine, 2-(acetyloxy)benzoate (1:1)
  • DL-Lysine, mono[2-(acetyloxy)benzoate]
  • Lysine, mono[2-(acetyloxy)benzoate]
  • Benzoic acid, 2-(acetyloxy)-, compd. with DL-lysine (1:1)
  • Benzoic acid, 2-(acetyloxy)-, compd. with lysine (1:1)

Deleted or Replaced CAS Registry Numbers

97598-63-5, 98806-35-0, 107032-89-3, 123445-32-9, 34220-70-7, 50641-50-4, 51024-94-3, 77337-52-1, 92520-58-6, 145607-63-2